21-(Acetyloxy) Tetraene (3-TR) manufacturers and suppliers on PharmaCompass

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Also known as: 37413-91-5, 2-((8s,10s,13s,14s)-10,13-dimethyl-3-oxo-6,7,8,10,12,13,14,15-octahydro-3h-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate, 21-acetoxypregna-1,4,9(11),16-tetraene-3,20-dione, 3,20-dioxopregna-1,4,9(11),16-tetraen-21-yl acetate, 21-(acetyloxy)-pregna-1,4,9(11),16-tetraene-3,20-dione, [2-[(8s,10s,13s,14s)-10,13-dimethyl-3-oxo-6,7,8,12,14,15-hexahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Molecular Formula
C23H26O4
Molecular Weight
366.4  g/mol
InChI Key
UFEOMHFPJREVTP-PTRHGPIFSA-N

21-(Acetyloxy) Tetraene (3-TR)
1 2D Structure

21-(Acetyloxy) Tetraene (3-TR)

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[2-[(8S,10S,13S,14S)-10,13-dimethyl-3-oxo-6,7,8,12,14,15-hexahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
2.1.2 InChI
InChI=1S/C23H26O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h7-10,12,17-18H,4-6,11,13H2,1-3H3/t17-,18-,22-,23-/m0/s1
2.1.3 InChI Key
UFEOMHFPJREVTP-PTRHGPIFSA-N
2.1.4 Canonical SMILES
CC(=O)OCC(=O)C1=CCC2C1(CC=C3C2CCC4=CC(=O)C=CC43C)C
2.1.5 Isomeric SMILES
CC(=O)OCC(=O)C1=CC[C@@H]2[C@@]1(CC=C3[C@H]2CCC4=CC(=O)C=C[C@@]43C)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 37413-91-5

2. 2-((8s,10s,13s,14s)-10,13-dimethyl-3-oxo-6,7,8,10,12,13,14,15-octahydro-3h-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl Acetate

3. 21-acetoxypregna-1,4,9(11),16-tetraene-3,20-dione

4. 3,20-dioxopregna-1,4,9(11),16-tetraen-21-yl Acetate

5. 21-(acetyloxy)-pregna-1,4,9(11),16-tetraene-3,20-dione

6. [2-[(8s,10s,13s,14s)-10,13-dimethyl-3-oxo-6,7,8,12,14,15-hexahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] Acetate

7. Pregna-1,4,9(11),16-tetraene-3,20-dione, 21-(acetyloxy)-

8. Einecs 253-497-3

9. Schembl8752386

10. Chembl2348787

11. Dtxsid60190855

12. Amy28659

13. Bcp10593

14. Pregna-1,4,9(11),16-tetraene-3,20-dione,21-(acetyloxy)-

15. Mfcd07783010

16. Zinc77270453

17. Akos016003151

18. Ac-8111

19. As-69509

20. Hy-136340

21. Cs-0128303

22. D92995

23. 413t915

24. A874119

25. W-106538

26. 21-acetoxypregna-1,4,9(11),16-tetrene-3,20-dione

27. 21-acetoxypregna-1,4,9(11),16(17)-tetraene-3,20-dione

28. 2-[(3as,3bs,9as,11as)-9a,11a-dimethyl-7-oxo-3h,3ah,3bh,4h,5h,7h,9ah,11h,11ah-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl Acetate

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 366.4 g/mol
Molecular Formula C23H26O4
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass366.18310931 g/mol
Monoisotopic Mass366.18310931 g/mol
Topological Polar Surface Area60.4 Ų
Heavy Atom Count27
Formal Charge0
Complexity856
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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SUPPLIERS

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EUROAPI

France
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Virtual BoothEUROAPI, the leading small molecules API player, provides both API sales & CDMO services.

21-hydroxypregna-1,4,9(11),16-tetraene3,20-dione-2...

CAS Number : 37413-91-5

End Use API :

About the Company : EUROAPI is the market leader in small molecule APIs with projected sales of about €1 billion in 2022. With around 200 APIs, it has one of the largest portfolios in the market. Thanks ...

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OPRD USA
Not Confirmed
  • fda
  • EDQM
  • WHO-GMP

Virtual BoothPfizer CentreOne is a global CDMO and a leading supplier of Specialty APIs.

21-(Acetyloxy) Tetraene (3-TR)

CAS Number : 37413-91-5

End Use API :

About the Company : Pfizer CentreOne® is an altogether different global contract development and manufacturing organization (CDMO), and a leading supplier of specialty APIs and intermediates.

...

Pfizer centreOne

03

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothMesochem is focused on incessant innovation along with the R&D of new APIs.

3,20-Dioxopregna-1,4,9(11),16-tetraen-21-yl acetat...

CAS Number : 37413-91-5

End Use API :

About the Company : Beijing Mesochem Technology Co. Ltd., which is located in the national economic and technological development area of Yizhuang, China, manufactures pharmaceutical chemicals, fine chemic...

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04

OPRD USA
Not Confirmed
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OPRD USA
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Tetraene Acetate (3TR)

CAS Number :

End Use API :

About the Company : Established in 2002, Aurisco is an innovative company dedicated to developing and manufacturing pharmaceutical chemicals serving pharmaceutical companies worldwide. The head office is l...

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END USE APIs

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01

EUROAPI

EUROAPI, the leading small molecules API player, provides both API sales & CDMO services.

Pfizer CentreOne

Pfizer CentreOne is a global CDMO and a leading supplier of Specialty APIs.

Symbiotec Pharmalab

Symbiotec: Global API manufacturer, specializing in Cortico-Steroids & Steroid-Hormone APIs.

Axplora

Axplora- The partner of choice for complex APIs.

LGM Pharma

LGM Pharma accelerates & optimizes the new product pathway from early development through commercialization.

DKSH

DKSH is your trusted partner for companies looking to grow their business in Asia & beyond.

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